Geometry & MOs

Info

ID:	297620
PubChem CID:	117624017
Reduced:	N6H34C49 (1)
Stoich.:	A6B34C49 (1)
Weight, g/mol:	512.225249
ΔH_f, kcal/mol:	270.63
Dipole, Da:	1.57
IP(EA), eV:	-8.81(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-[4-(5-naphthalen-2-ylbenzo[10]annulen-12-yl)phenyl]imidazo[1,2-a]pyridine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N2C3=C(C=CC=N3)N=C2C4=CC=CC(=C4)C5=CC=CC(=C5)C6=CC=C(C=C6)C7=CC=C(C=C7)C8=NC9=C(N8C1=CC=CC=C1)N=CC=C9

DOS

IR

Vibrations